ChemSpider 2D Image | 2-Methyl-8,12,14-icosatrienoic acid | C21H36O2

2-Methyl-8,12,14-icosatrienoic acid

  • Molecular FormulaC21H36O2
  • Average mass320.509 Da
  • Monoisotopic mass320.271515 Da
  • ChemSpider ID23353999

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Methyl-8,12,14-icosatrienoic acid [ACD/IUPAC Name]
2-Methyl-8,12,14-icosatriensäure [German] [ACD/IUPAC Name]
8,12,14-Eicosatrienoic acid, 2-methyl- [ACD/Index Name]
Acide 2-méthyl-8,12,14-icosatriénoïque [French] [ACD/IUPAC Name]
97516-41-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 450.5±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 77.8±6.0 kJ/mol
Flash Point: 347.1±18.0 °C
Index of Refraction: 1.487
Molar Refractivity: 101.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.78
ACD/LogD (pH 5.5): 6.55
ACD/BCF (pH 5.5): 36320.84
ACD/KOC (pH 5.5): 38703.94
ACD/LogD (pH 7.4): 4.75
ACD/BCF (pH 7.4): 587.25
ACD/KOC (pH 7.4): 625.78
Polar Surface Area: 37 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 351.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement